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Ligand · CQP

CQP · (4R,2S)-5'-(4-(4-chlorobenzyloxy)pyrrolidin-2-ylmethanesulfonyl)isoquinoline

CQP, (4R,2S)-5'-(4-(4-chlorobenzyloxy)pyrrolidin-2-ylmethanesulfonyl)isoquinoline (C21 H22 Cl N3 O3 S, 431.9 g/mol), in the MolNFT structures on GenesisL1: bound in 2 records (1 PDB entry). Every binding site with its residues within 4.5…

Component
CQP
Formula
C21 H22 Cl N3 O3 S
Class
ligand
Structures
2
PDB entries
1

Binding sites

CQP in 2 structures; the first of them:

  • 2C1B · Structure of cAMP-dependent protein kinase complexed with… · CQP A1351 · binds LEU49, GLY50, THR51, GLY52, GLY55, ARG56, VAL57, ALA70 and 14 more
  • 2C1B · Structure of camp-dependent protein kinase complexed with (4R,2S)-5'… · CQP A1351 · binds LEU49, GLY50, THR51, GLY52, GLY55, ARG56, VAL57, ALA70 and 14 more

Residues it binds most

GLU 2, GLY 2, LEU 2, ARG 2, THR 2, VAL 2, ALA 2, ASN 2, ASP 2, LYS 2 (residue and the binding sites it lines).

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